Vitas-M small molecule compound
2-chloro-4-(morpholin-4-ylcarbonothioyl)phenyl 3,5-dimethoxybenzoate
Catalog ID
STL416427
SMILES COc1cc(OC)cc(c1)C(=O)Oc1ccc(cc1Cl)C(=S)N1CCOCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H20ClNO5S MW 421.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClNO5S/c1-24-15-9-14(10-16(12-15)25-2)20(23)27-18-4-3-13(11-17(18)21)19(28)22-5-7-26-8-6-22/h3-4,9-12H,5-8H2,1-2H3InChIKey
NVLFPJZRGXBIQB-UHFFFAOYSA-NSynonyms
(2chloro4(morpholine4carbothioyl)phenyl)35dimethoxybenzoate
2chloro4(morpholin4ylcarbonothioyl)phenyl35dimethoxybenzoate
COC1=CC(=CC(=C1)C(=O)OC2=C(C=C(C=C2)C(=S)N3CCOCC3)Cl)OC
InChI=1SC20H20ClNO5Sc12415914(1016(1215)252)20(23)27184313(1117(18)21)19(28)2257268622h34912H58H212H3
MFCD02904029
ZINC000220962551
ZINC220962551
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